Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | 1-Butanol | HCID 263 | — |
| Reactant | Hydrochloric Acid | HCID 313 | — |
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Mechlorethamine | HCID 4033 | — |
| Reactant | Carbonate Ion | HCID 19660 | — |
| Reactant | Methyl 3-Amino-4-methoxybenzoate | HCID 2734814 | — |
| Product | Hydrochloric Acid | HCID 313 | — |
| Product | 4-Methoxy-3-(4-methyl-piperazin-1-yl)-benzoic acid methyl ester | HCID 10061354 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
| ORD ID | ord-40d0ab5f7d384470ab393ba6bfa1ff6b |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
